N-cyclopropyl-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide

C11H15N3O2 — CID 135896890

IUPACN-cyclopropyl-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide
SMILESCc1nc(C)c(CC(=O)NC2CC2)c(=O)[nH]1
InChIInChI=1S/C11H15N3O2/c1-6-9(11(16)13-7(2)12-6)5-10(15)14-8-3-4-8/h8H,3-5H2,1-2H3,(H,14,15)(H,12,13,16)
InChIKeyADCLQWWRWKRMDW-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.21
Rot. Bonds3

About N-cyclopropyl-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide

N-cyclopropyl-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide (PubChem CID 135896890) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is N-cyclopropyl-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide
PubChem CID135896890
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC NameN-cyclopropyl-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide
SMILESCc1nc(C)c(CC(=O)NC2CC2)c(=O)[nH]1
InChIInChI=1S/C11H15N3O2/c1-6-9(11(16)13-7(2)12-6)5-10(15)14-8-3-4-8/h8H,3-5H2,1-2H3,(H,14,15)(H,12,13,16)
InChIKeyADCLQWWRWKRMDW-UHFFFAOYSA-N
XLogP0.21
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-3H,4H,5H,6H,7H,8H,9H-pyrimido(4,5-d)azepin-4-one dihydrochloride
CID 154857238
2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(2-methylpropyl)acetamide
CID 135896886
N-cyclooctyl-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide
CID 135896975
2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 135931992
2-methyl-3,5,6,7,8,9-hexahydro-4H-pyrimido[4,5-d]azepin-4-one
CID 135671154
5-(2-aminoethyl)-2-methyl-4-(trifluoromethyl)-1H-pyrimidin-6-one
CID 136758124
2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(3-methylbutyl)acetamide
CID 135896967
2-methyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(3H)-one
CID 135741595
2-(2-butyl-4-hydroxy-6-methylpyrimidin-5-yl)-N,N-dimethylacetamide
CID 135741921
2-ethyl-5,6,7,8-tetrahydro-3H-pyrido[3,4-d]pyrimidin-4-one
CID 136036456
5-(2-aminoethyl)-4-ethyl-2-methyl-1H-pyrimidin-6-one
CID 136326131
2,7-dimethyl-5,6,8,9-tetrahydro-3H-pyrimido[4,5-d]azepin-4-one
CID 136327554

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide?
The IUPAC name of N-cyclopropyl-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide (CID 135896890) is N-cyclopropyl-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide.
What is the SMILES notation for N-cyclopropyl-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide?
The canonical SMILES for N-cyclopropyl-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide is Cc1nc(C)c(CC(=O)NC2CC2)c(=O)[nH]1.
What is the InChIKey of N-cyclopropyl-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide?
The InChIKey is ADCLQWWRWKRMDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-6-9(11(16)13-7(2)12-6)5-10(15)14-8-3-4-8/h8H,3-5H2,1-2H3,(H,14,15)(H,12,13,16).
What are the key properties of N-cyclopropyl-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide?
N-cyclopropyl-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide has a molecular weight of 221.26 g/mol, XLogP of 0.21, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide is sourced from PubChem (CID 135896890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).